3-[(4-tert-butylphenyl)methyl-[(3-methoxyphenyl)methyl]amino]propanoic acid

Systemtic Name: 3-[(4-tert-butylphenyl)methyl-[(3-methoxyphenyl)methyl]amino]propanoic acid Openeye Name: 3-[(4-tert-butylphenyl)methyl-[(3-methoxyphenyl)methyl]amino]propanoic acid CAS Name: 3-[(4-tert-butylphenyl)methyl-[(3-methoxyphenyl)methyl]amino]propanoic acid IUPAC Name: 3-[(4-tert-butylphenyl)methyl-[(3-methoxyphenyl)methyl]amino]propanoic acid Traditional Name: 3-[(4-tert-butylbenzyl)-m-anisyl-amino]propionic acid Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CCC(=O)O)CC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CCC(=O)O)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C22H29NO3/c1-22(2,3)19-10-8-17(9-11-19)15-23(13-12-21(24)25)16-18-6-5-7-20(14-18)26-4/h5-11,14H,12-13,15-16H2,1-4H3,(H,24,25)